Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 9/20 | 0.69 |
| ▸ | CHRM4 | P08173 | 8/20 | 0.55 |
| ▸ | CHRM5 | P08912 | 8/20 | 0.55 |
| ▸ | CHRM3 | P20309 | 8/20 | 0.55 |
| ▸ | CHRM2 | P08172 | 7/20 | 0.55 |
| ▸ | CHRM1 | P11229 | 7/20 | 0.55 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | HTR1A | P08908 | 1/20 | 0.51 |
| ▸ | DRD2 | P14416 | 1/20 | 0.51 |
| ▸ | DRD1 | P21728 | 1/20 | 0.51 |
| ▸ | HTR2A | P28223 | 1/20 | 0.51 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.51 |
| ▸ | DRD3 | P35462 | 1/20 | 0.51 |
| ▸ | SCN1A | P35498 | 1/20 | 0.51 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.51 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL5100291 | 0.94 | KIF11 (0.61) | KIF11CHRM4CHRM5CHRM3CHRM2 | |
| SCHEMBL5093516 | 0.92 | KIF11 (0.59) | KIF11CHRM4CHRM5CHRM3CHRM2 | |
| SCHEMBL5091996 | 0.92 | KIF11 (0.59) | KIF11CHRM4CHRM5CHRM3CHRM2 | |
| SCHEMBL11181214 | 0.86 | KIF11 (0.56) | KIF11CHRM4CHRM5CHRM3CHRM2 | |
| SCHEMBL4431781 | 0.86 | SIGMAR1 (0.66) | KIF11CHRM4CHRM5CHRM3CHRM2 | |
| Butylamine SCHEMBL9107548 | 0.83 | KIF11 (0.53) | KIF11CHRM4CHRM5CHRM3CHRM2 | |
| SCHEMBL2679441 | 0.82 | KIF11 (1.00) | KIF11KCNH2CYP2D6CYP3A4CYP2C9 | |
| SCHEMBL560935 | 0.81 | SMN1; SMN2 (0.61) | KIF11CHRM4CHRM5CHRM3CHRM2 | |
| Bromide SCHEMBL14976365 | 0.80 | KIF11 (0.95) | KIF11KCNH2CYP2D6CYP3A4CYP2C9 | |
| Water SCHEMBL11129297 | 0.80 | KIF11 (0.95) | KIF11KCNH2CYP2D6CYP3A4CYP2C9 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-54084578-A | — | — | None | — | — | JP | disclosed |
| JP-S5484578-A | NOVEL PREPARATION OF DIPHENYLBUTYLAMINE DERIVATIVE | SUMITOMO CHEM CO LTD | 1979-07-05 | — | — | JP | disclosed |
| US-4034011-A | 1,1-Diphenyl-4-(substituted-amino)butanes | ELI LILLY AND COMPANY (US) | 1977-07-05 | — | — | US | disclosed |